Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.37 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL333685 | 0.87 | ALDH1A1 (0.30) | ALDH1A1HSD17B10NPC1RAB9ANFKB1 | |
| SCHEMBL29492107 | 0.87 | ALDH1A1 (0.30) | ALDH1A1HSD17B10NPC1RAB9ANFKB1 | |
| SCHEMBL196673 | 0.78 | NPC1 (0.36) | ALDH1A1HPGDTSHRSMN1; SMN2NPC1 | |
| SCHEMBL29548615 | 0.78 | NPC1 (0.36) | ALDH1A1HPGDTSHRSMN1; SMN2NPC1 | |
| SCHEMBL316666 | 0.76 | — | — | |
| SCHEMBL4428859 | 0.76 | PTGS2 (0.37) | ALDH1A1HPGDHSD17B10BCL2L1TDP1 | |
| SCHEMBL29353415 | 0.75 | ALDH1A1 (0.38) | ALDH1A1HPGDHSD17B10BCL2L1TDP1 | |
| SCHEMBL56503 | 0.75 | ALDH1A1 (0.38) | ALDH1A1HPGDHSD17B10BCL2L1TDP1 | |
| SCHEMBL1315082 | 0.75 | MAPK1 (0.32) | ALDH1A1TDP1TSHRMAPK1 | |
| SCHEMBL30480018 | 0.75 | MAPK1 (0.32) | ALDH1A1TDP1TSHRMAPK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000068237-A1 | PD- AND NI COMPLEXES OF BIPHENYL-2-YL-PHOSPHANES AND THEIR USE IN CATALYTIC C,C-, C,N- AND C,O-COUPLINGS | CLARIANT GMBH (DE) | 2000-11-16 | — | — | WO | disclosed |